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877397-65-4 | (S);-1-(2,6-Dichloro-3-fluorophenyl);ethanol
CAS No: 877397-65-4 Catalog No: AG003CIN MDL No:MFCD09863793
Product Description
Catalog Number:
AG003CIN
Chemical Name:
(S);-1-(2,6-Dichloro-3-fluorophenyl);ethanol
CAS Number:
877397-65-4
Molecular Formula:
C8H7Cl2FO
Molecular Weight:
209.0450
MDL Number:
MFCD09863793
IUPAC Name:
(1S)-1-(2,6-dichloro-3-fluorophenyl)ethanol
InChI:
InChI=1S/C8H7Cl2FO/c1-4(12)7-5(9)2-3-6(11)8(7)10/h2-4,12H,1H3/t4-/m0/s1
InChI Key:
JAOYKRSASYNDGH-BYPYZUCNSA-N
SMILES:
C[C@@H](c1c(Cl)ccc(c1Cl)F)O
EC Number:
700-699-9
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
207.986g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.041g/mol
Monoisotopic Mass:
207.986g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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